Geometry & MOs

Info

ID:	263522
PubChem CID:	103375414
Reduced:	IOSN4H5C7 (1)
Stoich.:	ABCD4E5F7 (1)
Weight, g/mol:	259.106925
ΔH_f, kcal/mol:	93.02
Dipole, Da:	2.59
IP(EA), eV:	-9.43(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methoxypyridazin-3-yl)-5,6,7,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

COC1=NN=C(C=C1)C2=NSC(=N2)I

DOS

IR

Vibrations